3D structures mapped by conservation among orthologs

[ Domain: "ClpP/crotonase" // CLP_protease ]

 PyMOL session

[ Alpha Fold Model ] (go)

Known binders annotated in ChEMBL

 IC50 CSV

Only the first 20 rows are shown.

molecule_chembl_id	structure	assay_type	relation	value	unit	mol_wt	smiles	organism	assay_chembl_id	bao_label
CHEMBL4466041		IC50	=	390.0	nM	394.39	C#Cc1oc2ccc3ccccc3c2c1CC(=O)Oc1ccc(-c2nnco2)cc1	Homo sapiens	CHEMBL4305801	cell-based format